4,6-Diacetoxy-6-methyl-2,4-cyclohexadien-1-one(64248-35-7) ¹H NMR

Product Name4,6-Diacetoxy-6-methyl-2,4-cyclohexadien-1-one

CAS 64248-35-7

Molecular FormulaC11H12O5

Molecular Weight224.21

InChIInChI=1S/C11H12O5/c1-7(12)15-9-4-5-10(14)11(3,6-9)16-8(2)13/h4-6H,1-3H3

InChIKey VCQBMRKOBCTJNS-UHFFFAOYSA-N

SmilesC1(=O)C(OC(C)=O)(C)C=C(OC(C)=O)C=C1

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¹HNMR

    Parameter     ppm  Hz

      D(A)         6.08
      D(B)         6.71
      D(C)         5.85
       J(A,B)         10.2
       J(A,C)          0.7
       J(B,C)          2.9
     
      D(D)         2.17
     
      D(E)         2.03
     
      D(F)         1.40
     
     BUBB,W.A. ET AL. ORG.MAGN.RESON. 9, 167 (1977)

Spectral Code: 1H NMR : parameter in CCl4

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4,6-Diacetoxy-6-methyl-2,4-cyclohexadien-1-one(64248-35-7) 1H NMR

4,6-Diacetoxy-6-methyl-2,4-cyclohexadien-1-one(64248-35-7) ¹H NMR